N-{1-[(4-chlorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-2-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-{1-[(4-chlorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-2-methylbenzene-1-sulfonamide
N-{1-[(4-chlorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-2-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | D439-0384 |
| Compound Name: | N-{1-[(4-chlorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-2-methylbenzene-1-sulfonamide |
| Molecular Weight: | 362.84 |
| Molecular Formula: | C16 H15 Cl N4 O2 S |
| Smiles: | Cc1ccccc1S(Nc1ncn(Cc2ccc(cc2)[Cl])n1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2479 |
| logD: | 0.6286 |
| logSw: | -3.6601 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.11 |
| InChI Key: | BQRSXUHJFBKXSX-UHFFFAOYSA-N |